N-(3-azanylpropyl)-3-fluoranyl-N-[[3-[(4-nitrophenyl)carbonylamino]phenyl]methyl]benzamide

Systemtic Name: N-(3-azanylpropyl)-3-fluoranyl-N-[[3-[(4-nitrophenyl)carbonylamino]phenyl]methyl]benzamide Openeye Name: N-(3-aminopropyl)-3-fluoro-N-[[3-[(4-nitrobenzoyl)amino]phenyl]methyl]benzamide CAS Name: N-(3-aminopropyl)-3-fluoro-N-[[3-[[(4-nitrophenyl)-oxomethyl]amino]phenyl]methyl]benzamide IUPAC Name: N-(3-aminopropyl)-3-fluoro-N-[[3-[(4-nitrobenzoyl)amino]phenyl]methyl]benzamide Traditional Name: N-(3-aminopropyl)-3-fluoro-N-[3-[(4-nitrobenzoyl)amino]benzyl]benzamide Formula: C24H23FN4O4 MolecularWeight: 450.462223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])CN(CCCN)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])CN(CCCN)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C24H23FN4O4/c25-20-6-2-5-19(15-20)24(31)28(13-3-12-26)16-17-4-1-7-21(14-17)27-23(30)18-8-10-22(11-9-18)29(32)33/h1-2,4-11,14-15H,3,12-13,16,26H2,(H,27,30)